Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 5/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21547006 | 0.92 | KDM4E (0.35) | ADORA2AADORA1KDM4EATML3MBTL1 | |
| SCHEMBL21547058 | 0.89 | CYP11B2 (0.35) | ADORA2AADORA1KDM4EL3MBTL1PDCD1 | |
| SCHEMBL21547156 | 0.86 | ENPP1 (0.35) | ADORA2AKDM4EATML3MBTL1CFTR | |
| SCHEMBL22564420 | 0.85 | RXRA (0.34) | KDM4EATML3MBTL1 | |
| SCHEMBL21546509 | 0.85 | ADRA2C (0.36) | ADORA2AADORA1KDM4EPDCD1CD274 | |
| SCHEMBL22760985 | 0.84 | ADRA2C (0.34) | ADORA2AADORA1PDCD1CD274ADORA2B | |
| SCHEMBL21546966 | 0.84 | CHEK1 (0.36) | ADORA2AADORA1PDCD1CD274ADORA2B | |
| SCHEMBL22157168 | 0.84 | KDM4E (0.35) | KDM4EATML3MBTL1ALDH1A1LMNA | |
| SCHEMBL21546710 | 0.84 | PGR (0.34) | ADORA2AADORA1ADRA2CALDH1A1LMNA | |
| SCHEMBL21546486 | 0.84 | KDM4E (0.42) | ADORA2AADORA1KDM4EATML3MBTL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3478793-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-11-06 | — | — | EP | disclosed |